N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide

C15H28N2O — CID 55164553

IUPACN-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide
SMILESCCN(C(=O)C1(CC)CCNC1)C1CCCCC1
InChIInChI=1S/C15H28N2O/c1-3-15(10-11-16-12-15)14(18)17(4-2)13-8-6-5-7-9-13/h13,16H,3-12H2,1-2H3
InChIKeyHLGCWJBDWYHTCD-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.56
Rot. Bonds4

About N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide

N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide (PubChem CID 55164553) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide
PubChem CID55164553
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide
SMILESCCN(C(=O)C1(CC)CCNC1)C1CCCCC1
InChIInChI=1S/C15H28N2O/c1-3-15(10-11-16-12-15)14(18)17(4-2)13-8-6-5-7-9-13/h13,16H,3-12H2,1-2H3
InChIKeyHLGCWJBDWYHTCD-UHFFFAOYSA-N
XLogP2.56
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide (CID 55164553) is N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide is CCN(C(=O)C1(CC)CCNC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide?
The InChIKey is HLGCWJBDWYHTCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-15(10-11-16-12-15)14(18)17(4-2)13-8-6-5-7-9-13/h13,16H,3-12H2,1-2H3.
What are the key properties of N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide?
N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,3-diethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 55164553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).